view article
Figure 3
Comparison of X—H bond lengths (in Å) obtained from various HAR refinements and multipole models. The acidic and phenolic O—H bonds have individual entries, whereas O—H(w) is an average of four bonds and similarly Car-H is an average of all the aromatic C—H bonds. The `Neutron' entry refers to averaged values from Allen & Bruno (2010BB2). The `MP' entry refers to the refined distances, but it has to be recalled that the X—H bond lengths were restrained to the standard neutron values.

Journal logoSTRUCTURAL SCIENCE
CRYSTAL ENGINEERING
MATERIALS
ISSN: 2052-5206
Volume 78| Part 2| April 2022| Pages 231-246
https://doi.org/10.1107/S2052520622001457
Follow Acta Cryst. B
Sign up for e-alerts
E-alerts
Follow Acta Cryst. on Twitter
Twitter
Follow us on facebook
Facebook
Sign up for RSS feeds
RSS